4-chloranyl-2,5-dimethyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-2,5-dimethyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide Openeye Name: 4-chloro-2,5-dimethyl-N-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethyl]benzenesulfonamide CAS Name: 4-chloro-2,5-dimethyl-N-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethyl]benzenesulfonamide IUPAC Name: 4-chloro-2,5-dimethyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide Traditional Name: 4-chloro-2,5-dimethyl-N-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethyl]benzenesulfonamide Formula: C20H18ClF3N2O2S2 MolecularWeight: 474.94733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NCCSC2=CC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NCCSC2=CC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C20H18ClF3N2O2S2/c1-12-10-18(13(2)9-15(12)21)30(27,28)25-7-8-29-17-11-19(20(22,23)24)26-16-6-4-3-5-14(16)17/h3-6,9-11,25H,7-8H2,1-2H3